| SpectraBase Compound ID | 5qcnVyJXnbG |
|---|---|
| InChI | InChI=1S/C16H17O3PS/c21-20(17-12-4-5-13-18-20)16-10-8-15(9-11-16)19-14-6-2-1-3-7-14/h1-3,6-11H,4-5,12-13H2 |
| InChIKey | MGBXNEIEYJNNEB-UHFFFAOYSA-N |
| Mol Weight | 320.34 g/mol |
| Molecular Formula | C16H17O3PS |
| Exact Mass | 320.063603 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Fyhd6AKdZ1O |
|---|---|
| Name | 2-(4-Benzoylphenyl)-1,3,2-dioxaphosphorepane-2-sulfide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 320.063602576 u |
| Formula | C16H17O3PS |
| InChI | InChI=1S/C16H17O3PS/c21-20(17-12-4-5-13-18-20)16-10-8-15(9-11-16)19-14-6-2-1-3-7-14/h1-3,6-11H,4-5,12-13H2 |
| InChIKey | MGBXNEIEYJNNEB-UHFFFAOYSA-N |
| Molecular Weight | 320.343 g/mol |
| SMILES | C1(P2(=S)OCCCCO2)=CC=C(OC2=CC=CC=C2)C=C1 |